AG0024Q2

176523-95-8 | 3-Piperidinecarboxylic acid, 3-methyl-, ethyl ester, hydrochloride (1:1)

AG0024Q2

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CAS Number	176523-95-8
Catalog Number	AG0024Q2(AGN-PC-0IOOE0)
Chemical Name	3-Piperidinecarboxylic acid, 3-methyl-, ethyl ester, hydrochloride (1:1)
IUPAC Name	ethyl 3-methylpiperidine-3-carboxylate;hydrochloride
InChI	InChI=1S/C9H17NO2.ClH/c1-3-12-8(11)9(2)5-4-6-10-7-9;/h10H,3-7H2,1-2H3;1H
InChI Key	IPAHPPZMOMRABY-UHFFFAOYSA-N
MDL Number	MFCD15142861
Molecular Formula	C9H18ClNO2
Molecular Weight	207.6977
SMILES	O=C(C1(C)CNCCC1)OCC.[H]Cl
Synonyms	Ethyl 3-methylpiperidine-3-carboxylate hydrochloride, 176523-95-8, ETHYL 3-METHYLPIPERIDINE-3-CARBOXYLATE HCL, AK109320, 3-Methyl-piperidine-3-carboxylic acid ethyl ester hydrochloride, SCHEMBL7093253, CTK8C5019, KS-00000QWP, DTXSID50741592, ANW-73769, MFCD15142861, AKOS016007812, CS-W005754, DS-4193, AX8242154, ST2419338, TC-162514, 4CH-012259, FT-0722492, X-3364, Ethyl 3-methylpiperidine-3-carboxylate--hydrogen chloride (1/1), 3-Piperidinecarboxylic acid, 3-methyl-, ethyl ester, hydrochloride (1:1), Ethyl3-methylpiperidine-3-carboxylatehydrochloride, 170843-43-3,

Complexity	170
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	207.103g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	207.698g/mol
Monoisotopic Mass	207.103g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	38.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number